C22H13BrClNO4
TL;DR: C22H13BrClNO4 (CAS 845653-46-5) is a chemical compound with molecular formula C22H13BrClNO4 and molecular weight 468.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-bromo-1-(3-chlorophenyl)-2-(furan-2-ylmethyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione
Also Known As: 7-bromo-1-(3-chlorophenyl)-2-(furan-2-ylmethyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione, 7-bromo-1-(3-chlorophenyl)-2-(2-furylmethyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione, 7-bromo-1-(3-chlorophenyl)-2-(furan-2-ylmethyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione, 7-bromo-1-(3-chlorophenyl)-2-[(furan-2-yl)methyl]-1H,2H,3H,9H-chromeno[2,3-c]pyrrole-3,9-dione
| Molecular Formula | C22H13BrClNO4 |
|---|---|
| Molecular Weight | 468.97 g/mol |
| LogP | 5.5473 |
| Topological Polar Surface Area | 63.66 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 468.97165 |
| Heavy Atoms | 29 |
| Complexity | 1312.394 |
Chemical Identifiers
| CAS Number | 845653-46-5 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Cl)C2C3=C(C(=O)N2CC4=CC=CO4)OC5=C(C3=O)C=C(C=C5)Br |
Product Overview
C22H13BrClNO4 (CAS 845653-46-5), with molecular formula C22H13BrClNO4 and molecular weight 468.97 g/mol. IUPAC: 7-bromo-1-(3-chlorophenyl)-2-(furan-2-ylmethyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione.
Chemical Property Profile of C22H13BrClNO4
Property Insights of C22H13BrClNO4
The XLogP value of 5.5473 indicates that C22H13BrClNO4 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.66 Ų falls within the moderate polarity range, balancing permeability and solubility for C22H13BrClNO4. Following Lipinski's Rule of Five, C22H13BrClNO4 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C22H13BrClNO4?
The CAS number of C22H13BrClNO4 is 845653-46-5.
What is the molecular formula of C22H13BrClNO4?
The molecular formula of C22H13BrClNO4 is C22H13BrClNO4.
What is the molecular weight of C22H13BrClNO4?
The molecular weight of C22H13BrClNO4 is 468.97 g/mol.
Where can I buy C22H13BrClNO4?
You can request a quote for C22H13BrClNO4 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C22H13BrClNO4?
Yes, KEHONG BIO provides custom synthesis services for C22H13BrClNO4 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.